4-(4-methylpiperidin-1-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine chloride

Systemtic Name: 4-(4-methylpiperidin-1-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine chloride Openeye Name: 4-(4-methylpiperidin-1-ium-1-yl)benzofuro[3,2-d]pyrimidine chloride CAS Name: 4-(4-methyl-1-piperidin-1-iumyl)benzofuro[3,2-d]pyrimidine chloride IUPAC Name: 4-(4-methylpiperidin-1-ium-1-yl)-[1]benzofuro[3,2-d]pyrimidine chloride Traditional Name: 4-(4-methylpiperidin-1-ium-1-yl)benzofuro[3,2-d]pyrimidine chloride Formula: C16H18ClN3O MolecularWeight: 303.78662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C2=NC=NC3=C2OC4=CC=CC=C43.[Cl-]

Isomeric SMILES

CC1CC[NH+](CC1)C2=NC=NC3=C2OC4=CC=CC=C43.[Cl-]

InChI

InChI=1S/C16H17N3O.ClH/c1-11-6-8-19(9-7-11)16-15-14(17-10-18-16)12-4-2-3-5-13(12)20-15;/h2-5,10-11H,6-9H2,1H3;1H